[1-(4-aminophenyl)carbonyloxy-2-methyl-propan-2-yl]-heptyl-azanium chloride

Systemtic Name: [1-(4-aminophenyl)carbonyloxy-2-methyl-propan-2-yl]-heptyl-azanium chloride Openeye Name: [2-(4-aminobenzoyl)oxy-1,1-dimethyl-ethyl]-heptyl-ammonium chloride CAS Name: [1-[(4-aminophenyl)-oxomethoxy]-2-methylpropan-2-yl]-heptylammonium chloride IUPAC Name: [1-(4-aminobenzoyl)oxy-2-methylpropan-2-yl]-heptylazanium chloride Traditional Name: [2-(4-aminobenzoyl)oxy-1,1-dimethyl-ethyl]-heptyl-ammonium chloride Formula: C18H31ClN2O2 MolecularWeight: 342.90394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[NH2+]C(C)(C)COC(=O)C1=CC=C(C=C1)N.[Cl-]

Isomeric SMILES

CCCCCCC[NH2+]C(C)(C)COC(=O)C1=CC=C(C=C1)N.[Cl-]

InChI

InChI=1S/C18H30N2O2.ClH/c1-4-5-6-7-8-13-20-18(2,3)14-22-17(21)15-9-11-16(19)12-10-15;/h9-12,20H,4-8,13-14,19H2,1-3H3;1H